clidinium   Click here for help

GtoPdb Ligand ID: 366

Synonyms: Quarzan®
Approved drug
clidinium is an approved drug
Compound class: Synthetic organic
Comment: Clidinium is an antagonist of the muscarinic M1 and M3 acetylcholine receptors. The branded drug Librax® contains clidinium bromide and chlordiazepoxide.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 46.53
Molecular weight 352.19
XLogP 2.97
No. Lipinski's rules broken 0
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Canonical SMILES O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2
Isomeric SMILES O=C(C(c1ccccc1)(c1ccccc1)O)OC1C[N+]2(C)CCC1CC2
InChI InChI=1S/C22H26NO3/c1-23-14-12-17(13-15-23)20(16-23)26-21(24)22(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,17,20,25H,12-16H2,1H3/q+1
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
(1-methyl-1-azoniabicyclo[2.2.2]octan-8-yl) 2-hydroxy-2,2-di(phenyl)acetate
International Nonproprietary Names Click here for help
INN number INN
463 clidinium bromide
Synonyms Click here for help
Database Links Click here for help
Specialist databases
GPCRdb Ligand clidinium
Other databases
CAS Registry No. 7020-55-5 (source: Scifinder)
ChEBI CHEBI:126351
DrugBank Ligand DB00771
DrugCentral Ligand 676
GtoPdb PubChem SID 135650108
PubChem CID 2784
Search Google for chemical match using the InChIKey HOOSGZJRQIVJSZ-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HOOSGZJRQIVJSZ
Search PubMed clinical trials clidinium bromide
Search PubMed titles clidinium bromide
Search PubMed titles/abstracts clidinium bromide
UniChem Compound Search for chemical match using the InChIKey HOOSGZJRQIVJSZ-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey HOOSGZJRQIVJSZ-UHFFFAOYSA-N
Wikipedia Clidinium_bromide